N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(3-methylpyrazol-1-yl)propanamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(3-methylpyrazol-1-yl)propanamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(3-methylpyrazol-1-yl)propanamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-3-(3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(3-methylpyrazol-1-yl)propanamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(3-methylpyrazol-1-yl)propionamide Formula: C19H33N4O+ MolecularWeight: 333.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CCC(=O)NC2CCC[NH+](C2)C3CCCCCC3

Isomeric SMILES

CC1=NN(C=C1)CCC(=O)N[C@H]2CCC[NH+](C2)C3CCCCCC3

InChI

InChI=1S/C19H32N4O/c1-16-10-13-23(21-16)14-11-19(24)20-17-7-6-12-22(15-17)18-8-4-2-3-5-9-18/h10,13,17-18H,2-9,11-12,14-15H2,1H3,(H,20,24)/p+1/t17-/m0/s1